200,000+ products from a single source!
sales@angenechem.com
188709-49-1 | Benzoic acid, 4-[2-[4-[methyl(1-oxooctadecyl)amino]phenyl]diazenyl]-
CAS No: 188709-49-1 Catalog No: AG002H6D MDL No:
Product Description
Catalog Number:
AG002H6D
Chemical Name:
Benzoic acid, 4-[2-[4-[methyl(1-oxooctadecyl)amino]phenyl]diazenyl]-
CAS Number:
188709-49-1
Molecular Formula:
C32H47N3O3
Molecular Weight:
521.7339
IUPAC Name:
4-[[4-[methyl(octadecanoyl)amino]phenyl]diazenyl]benzoic acid
InChI:
InChI=1S/C32H47N3O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-31(36)35(2)30-25-23-29(24-26-30)34-33-28-21-19-27(20-22-28)32(37)38/h19-26H,3-18H2,1-2H3,(H,37,38)
InChI Key:
SGKVMJWHGPPTQA-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCCCCCCC(=O)N(c1ccc(cc1)N=Nc1ccc(cc1)C(=O)O)C
Properties
Complexity:
652
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
521.362g/mol
Formal Charge:
0
Heavy Atom Count:
38
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
521.746g/mol
Monoisotopic Mass:
521.362g/mol
Rotatable Bond Count:
20
Topological Polar Surface Area:
82.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
11
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.